Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | ADRB1 | P08588 | 5/20 | 0.40 |
| ▸ | ADRB3 | P13945 | 3/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.37 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL14027362 | 0.88 | ADRB2 (0.46) | CYP3A4CYP2D6KMT2AMEN1ADRB1 | |
| SCHEMBL5630733 | 0.87 | LMNA (0.47) | CYP3A4CYP2D6KMT2AADRB1ADRB3 | |
| SCHEMBL8263307 | 0.86 | ADRB1 (0.47) | CYP3A4KMT2AADRB1ADRB3ADRB2 | |
| SCHEMBL9462169 | 0.86 | CYP3A4 (0.49) | CYP3A4CYP2D6KMT2AMEN1ADRB1 | |
| SCHEMBL4887668 | 0.83 | ADRB2 (0.43) | CYP3A4KMT2AADRB1ADRB2CYP1A2 | |
| SCHEMBL5630730 | 0.83 | MAPT (0.44) | CYP3A4CYP2D6KMT2AADRB1ADRB2 | |
| SCHEMBL5631067 | 0.83 | MAPT (0.44) | CYP3A4CYP2D6KMT2AADRB1ADRB2 | |
| SCHEMBL4890684 | 0.83 | ADRB2 (0.38) | CYP3A4CYP2D6KMT2AMEN1ADRB1 | |
| SCHEMBL4884792 | 0.83 | MAPT (0.39) | CYP2D6KMT2AMEN1ADRB1ADRB3 | |
| SCHEMBL4890601 | 0.83 | CA12 (0.43) | KMT2AMEN1ADRB1ADRB3ADRB2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5204463-A | Substituted methoxyphenyl-4,5 dihydro-3(2H)-pridazinones having cardiotonic and beta blocking activities | GLAXO INC. (US) | 1993-04-20 | — | — | US | disclosed |
| US-5096904-A | Congestive heart failure | GLAXO INC. (US) | 1992-03-17 | — | — | US | disclosed |
| US-5053338-A | Hydrolysis of ester to obtain an optically enriched mixture of a phenol enantiomer | GLAXO INC. (US) | 1991-10-01 | — | — | US | disclosed |
| EP-0412814-A2 | Pyridazinones having cardiotonic and beta blocking activity | GLAXO WELLCOME INC. (US) | 1991-02-13 | — | — | EP | disclosed |